CID 4095651

2-(3-methoxy-4-(2-methoxyethoxy)phenyl)-1h-imidazo(4,5-b)phenazine

Structural Information

Molecular Formula
C23H20N4O3
SMILES
COCCOC1=C(C=C(C=C1)C2=NC3=CC4=NC5=CC=CC=C5NC4=CC3=N2)OC
InChI
InChI=1S/C23H20N4O3/c1-28-9-10-30-21-8-7-14(11-22(21)29-2)23-26-19-12-17-18(13-20(19)27-23)25-16-6-4-3-5-15(16)24-17/h3-8,11-13,24H,9-10H2,1-2H3
InChIKey
YMXHTQSROASJFL-UHFFFAOYSA-N
Compound name
2-[3-methoxy-4-(2-methoxyethoxy)phenyl]-10H-imidazo[4,5-b]phenazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

400.15353 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 401.160806 197.3
[M+Na]+ 423.142748 208.8
[M-H]- 399.146254 201.4
[M+NH4]+ 418.187353 206.8
[M+K]+ 439.116688 201.0
[M+H-H2O]+ 383.150790 185.3
[M+HCOO]- 445.151731 214.2
[M+CH3COO]- 459.167381 206.5
[M+Na-2H]- 421.128196 203.9
[M]+ 400.15298142 204.8
[M]- 400.15407858 204.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.